COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK925813
Chemical Name: (2E)-3-(6-bromo-4H-1,3-benzodioxin-8-yl)-1-(5-chloro-2-hydroxyphenyl)prop-2-en-1-one
Smiles: Brc1cc(/C=C/C(=O)c2cc(Cl)ccc2O)c2c(c1)COCO2

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Molecular Weight: 395.64
Empirical Formula: C17H12BrClO4

Available Amount: 0 mg

Lipinsky:
logP: 5.439
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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